COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.342   0.135  -2.040  1.00  0.00           C  
HETATM    2  O   UNL     1       3.864  -0.265   3.758  1.00  0.00           O  
HETATM    3  C   UNL     1      -2.080  -0.133  -4.849  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.220  -0.237   0.710  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.269  -0.390   1.812  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.581  -0.363   3.179  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.631  -0.516   4.281  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.634   0.635   4.193  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.322   0.608   2.827  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.273   0.761   1.724  1.00  0.00           C  
HETATM   11  C   UNL     1       4.279   0.757   1.651  1.00  0.00           C  
HETATM   12  C   UNL     1       3.566  -0.136   2.437  1.00  0.00           C  
HETATM   13  C   UNL     1       2.555  -0.901   1.877  1.00  0.00           C  
HETATM   14  C   UNL     1       2.248  -0.766   0.537  1.00  0.00           C  
HETATM   15  N   UNL     1       0.381  -0.005  -1.136  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.889  -0.124  -1.497  1.00  0.00           C  
HETATM   17  O   UNL     1      -1.862  -0.262  -0.566  1.00  0.00           O  
HETATM   18  C   UNL     1      -1.203  -0.109  -2.865  1.00  0.00           C  
HETATM   19  N   UNL     1      -2.351  -0.208  -3.579  1.00  0.00           N  
HETATM   20  N   UNL     1      -0.736   0.017  -5.030  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.153   0.035  -3.788  1.00  0.00           C  
HETATM   22  N   UNL     1       1.091   0.154  -3.340  1.00  0.00           N  
HETATM   23  N   UNL     1       2.654   0.261  -1.610  1.00  0.00           N  
HETATM   24  C   UNL     1       2.960   0.127  -0.250  1.00  0.00           C  
HETATM   25  C   UNL     1       3.977   0.889   0.310  1.00  0.00           C  
HETATM   26  H   UNL     1       3.315   0.373   4.232  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.810  -0.183  -5.642  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.505  -1.058   0.772  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.697   0.710   0.835  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.792  -1.338   1.687  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.866  -1.184   3.241  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.058   0.584   3.304  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.154  -1.464   4.156  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.141  -0.497   5.255  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.382   0.526   4.979  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.111   1.583   4.318  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.845  -0.339   2.702  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.037   1.429   2.764  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.749   1.709   1.849  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.763   0.742   0.751  1.00  0.00           H  
HETATM   41  H   UNL     1       5.069   1.349   2.087  1.00  0.00           H  
HETATM   42  H   UNL     1       2.001  -1.597   2.490  1.00  0.00           H  
HETATM   43  H   UNL     1       1.457  -1.359   0.101  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.277   0.096  -5.881  1.00  0.00           H  
HETATM   45  H   UNL     1       3.359   0.441  -2.251  1.00  0.00           H  
HETATM   46  H   UNL     1       4.531   1.585  -0.302  1.00  0.00           H  
CONECT    1   15   15   22   23                                       
CONECT    2   12   26                                                 
CONECT    3   19   19   20   27                                       
CONECT    4    5   17   28   29                                       
CONECT    5    4    6   10   30                                       
CONECT    6    5    7   31   32                                       
CONECT    7    6    8   33   34                                       
CONECT    8    7    9   35   36                                       
CONECT    9    8   10   37   38                                       
CONECT   10    5    9   39   40                                       
CONECT   11   12   12   25   41                                       
CONECT   12    2   11   11   13                                       
CONECT   13   12   14   14   42                                       
CONECT   14   13   13   24   43                                       
CONECT   15    1    1   16                                            
CONECT   16   15   17   18   18                                       
CONECT   17    4   16                                                 
CONECT   18   16   16   19   21                                       
CONECT   19    3    3   18                                            
CONECT   20    3   21   44                                            
CONECT   21   18   20   22   22                                       
CONECT   22    1   21   21                                            
CONECT   23    1   24   45                                            
CONECT   24   14   23   25   25                                       
CONECT   25   11   24   24   46                                       
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   20                                                      
CONECT   45   23                                                      
CONECT   46   25                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
